SCHEMBL8067719

SCHEMBL8067719

CS(=O)(=O)N[C@H]1CC[C@H](Cn2nnc(-c3cc(C(=O)NCc4ccc(F)c(Cl)c4)ncn3)n2)CC1

nearest known ligand 0.59

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 20/20 0.59
SLC22A8 Q8TCC7 1/20 0.45

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3803124 0.90 MMP13 (0.60) MMP13
SCHEMBL3803121 0.90 MMP13 (0.60) MMP13
SCHEMBL8058065 0.88 MMP13 (0.61) MMP13SLC22A8
SCHEMBL8071661 0.85 MMP13 (0.81) MMP13SLC22A8
SCHEMBL8076870 0.80 MMP13 (0.61) MMP13SLC22A8
SCHEMBL8069424 0.80 MMP13 (0.68) MMP13
SCHEMBL3801187 0.79 MMP13 (0.64) MMP13SLC22A8
SCHEMBL3801193 0.79 MMP13 (0.64) MMP13SLC22A8
SCHEMBL8070101 0.78 MMP13 (0.72) MMP13SLC22A8
SCHEMBL8065056 0.78 MMP13 (0.80) MMP13SLC22A8

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009016498-A1 PYRIMIDINE AND PYRIDINE DERIVATIVES AND THEIR PHARMACEUTICAL USE AND COMPOSITIONS PFIZER INC. (US) 2009-02-05 WO disclosed